ChemSpider 2D Image | {4-[(4-Chlorophenyl)sulfonyl]-1-piperazinyl}[2-(1H-tetrazol-1-yl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]methanone | C19H19ClN6O3S2

{4-[(4-Chlorophenyl)sulfonyl]-1-piperazinyl}[2-(1H-tetrazol-1-yl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]methanone

  • Molecular FormulaC19H19ClN6O3S2
  • Average mass478.976 Da
  • Monoisotopic mass478.064850 Da
  • ChemSpider ID58176346

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

{4-[(4-Chlorophenyl)sulfonyl]-1-piperazinyl}[2-(1H-tetrazol-1-yl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]methanone [ACD/IUPAC Name]
{4-[(4-Chlorophényl)sulfonyl]-1-pipérazinyl}[2-(1H-tétrazol-1-yl)-5,6-dihydro-4H-cyclopenta[b]thiophén-3-yl]méthanone [French] [ACD/IUPAC Name]
{4-[(4-Chlorphenyl)sulfonyl]-1-piperazinyl}[2-(1H-tetrazol-1-yl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]methanon [German] [ACD/IUPAC Name]
Methanone, [4-[(4-chlorophenyl)sulfonyl]-1-piperazinyl][5,6-dihydro-2-(1H-tetrazol-1-yl)-4H-cyclopenta[b]thien-3-yl]- [ACD/Index Name]
(2-(1H-tetrazol-1-yl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl)(4-((4-chlorophenyl)sulfonyl)piperazin-1-yl)methanone
1-[(4-chlorophenyl)sulfonyl]-4-{[2-(1H-tetrazol-1-yl)-5,6-dihydro-4H-cyclopenta[b]thien-3-yl]carbonyl}piperazine

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.7±0.1 g/cm3
Boiling Point: 755.9±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 110.1±3.0 kJ/mol
Flash Point: 411.0±35.7 °C
Index of Refraction: 1.802
Molar Refractivity: 121.4±0.5 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.58
ACD/LogD (pH 5.5): 2.37
ACD/BCF (pH 5.5): 36.97
ACD/KOC (pH 5.5): 461.24
ACD/LogD (pH 7.4): 2.37
ACD/BCF (pH 7.4): 36.98
ACD/KOC (pH 7.4): 461.24
Polar Surface Area: 138 Å2
Polarizability: 48.1±0.5 10-24cm3
Surface Tension: 77.3±7.0 dyne/cm
Molar Volume: 283.5±7.0 cm3

Click to predict properties on the Chemicalize site


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